4-[[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]-N-(phenylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]-N-(phenylmethyl)cyclohexane-1-carboxamide Openeye Name: N-benzyl-4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexanecarboxamide CAS Name: 4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]-N-(phenylmethyl)-1-cyclohexanecarboxamide IUPAC Name: N-benzyl-4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide Traditional Name: N-benzyl-4-[[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexanecarboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)NCC3CCC(CC3)C(=O)NCC4=CC=CC=C4)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)NCC3CCC(CC3)C(=O)NCC4=CC=CC=C4)NC(=O)C1

InChI

InChI=1S/C25H31N3O4S/c29-24-8-4-7-21-15-22(13-14-23(21)28-24)33(31,32)27-17-19-9-11-20(12-10-19)25(30)26-16-18-5-2-1-3-6-18/h1-3,5-6,13-15,19-20,27H,4,7-12,16-17H2,(H,26,30)(H,28,29)